==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GLYCOSYLTRANSFERASE 26-SEP-97 1LTM . COMPND 2 MOLECULE: 36 KDA SOLUBLE LYTIC TRANSGLYCOSYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR E.J.VAN ASSELT,B.W.DIJKSTRA . 309 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14928.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 215 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 16 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 128 41.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 2 3 1 0 1 1 1 1 2 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 2 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 42 A E 0 0 225 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-169.3 24.6 35.0 -20.0 2 43 A P + 0 0 62 0, 0.0 33,-0.2 0, 0.0 0, 0.0 0.840 360.0 176.3 -57.6 -57.6 23.7 38.6 -18.6 3 44 A Q > + 0 0 99 1,-0.1 3,-2.0 2,-0.1 0, 0.0 0.818 13.0 163.6 47.1 40.6 20.1 39.5 -19.7 4 45 A H T 3 S+ 0 0 149 1,-0.3 -1,-0.1 3,-0.0 30,-0.0 0.788 71.3 56.9 -54.8 -31.7 20.3 42.8 -17.7 5 46 A N T 3 S+ 0 0 144 1,-0.1 2,-1.3 2,-0.1 -1,-0.3 0.407 79.8 90.7 -83.0 -1.3 17.2 44.1 -19.7 6 47 A V < + 0 0 57 -3,-2.0 -1,-0.1 1,-0.2 3,-0.0 -0.748 48.3 150.5 -95.4 81.2 14.9 41.1 -18.7 7 48 A M + 0 0 109 -2,-1.3 2,-0.5 1,-0.1 -1,-0.2 0.435 48.3 65.9 -93.9 -4.7 13.6 42.9 -15.6 8 49 A Q - 0 0 113 -3,-0.1 2,-0.2 7,-0.0 -1,-0.1 -0.960 64.0-158.1-130.4 118.5 10.1 41.4 -15.5 9 50 A M - 0 0 14 -2,-0.5 2,-0.1 5,-0.2 30,-0.1 -0.485 11.0-138.7 -85.3 158.7 9.3 37.7 -14.7 10 51 A G + 0 0 40 -2,-0.2 3,-0.4 28,-0.2 -1,-0.1 -0.139 52.5 73.1 -99.1-160.7 6.1 35.9 -15.7 11 52 A G S > S- 0 0 46 1,-0.2 3,-2.0 2,-0.1 4,-0.2 -0.188 99.7 -38.7 86.6-177.7 4.1 33.4 -13.7 12 53 A D T 3 S+ 0 0 91 32,-0.6 -1,-0.2 1,-0.3 3,-0.2 0.629 138.6 44.3 -59.1 -20.4 1.7 33.6 -10.7 13 54 A F T > S+ 0 0 0 -3,-0.4 3,-1.6 28,-0.3 -1,-0.3 0.188 77.8 123.0-112.8 18.5 3.9 36.2 -8.9 14 55 A A T < S+ 0 0 18 -3,-2.0 -5,-0.2 1,-0.3 -1,-0.1 0.798 82.9 25.0 -46.6 -51.5 4.5 38.4 -12.0 15 56 A N T 3 S+ 0 0 144 -4,-0.2 -1,-0.3 -3,-0.2 -5,-0.0 -0.252 89.9 131.7-115.3 46.0 3.2 41.7 -10.8 16 57 A N <> - 0 0 18 -3,-1.6 4,-1.9 1,-0.1 3,-0.2 -0.873 45.3-158.2-104.1 116.2 3.7 41.1 -7.1 17 58 A P H > S+ 0 0 84 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.871 94.8 54.5 -56.8 -40.6 5.4 43.9 -5.1 18 59 A N H > S+ 0 0 70 114,-0.3 4,-2.2 1,-0.2 5,-0.1 0.891 105.9 50.4 -62.8 -42.7 6.4 41.4 -2.4 19 60 A A H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.913 111.1 50.6 -62.7 -40.9 8.2 39.1 -4.8 20 61 A Q H X S+ 0 0 34 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.918 111.0 46.3 -62.8 -47.4 10.1 42.0 -6.2 21 62 A Q H X S+ 0 0 122 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.871 111.2 54.6 -62.2 -39.2 11.3 43.3 -2.8 22 63 A F H X S+ 0 0 6 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.909 106.8 48.9 -61.7 -45.2 12.2 39.7 -1.9 23 64 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.947 110.5 52.7 -60.1 -44.9 14.4 39.3 -5.0 24 65 A D H X S+ 0 0 88 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.913 109.0 49.3 -56.5 -45.3 16.1 42.6 -4.2 25 66 A K H X>S+ 0 0 88 -4,-2.4 4,-2.9 1,-0.2 5,-0.5 0.916 111.9 47.9 -61.6 -43.6 16.8 41.3 -0.6 26 67 A M H X5S+ 0 0 0 -4,-2.4 4,-1.6 3,-0.2 6,-1.6 0.884 116.1 43.3 -65.1 -40.9 18.3 38.1 -1.9 27 68 A V H X5S+ 0 0 51 -4,-2.6 4,-1.4 4,-0.2 -2,-0.2 0.965 121.0 40.9 -66.7 -51.8 20.5 39.8 -4.5 28 69 A N H <5S+ 0 0 142 -4,-2.9 -2,-0.2 -5,-0.3 -3,-0.2 0.945 126.8 30.5 -62.2 -54.2 21.6 42.5 -2.1 29 70 A K H <5S+ 0 0 117 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.2 0.862 133.6 24.3 -80.2 -36.1 22.1 40.4 1.0 30 71 A H H < - 0 0 61 1,-0.1 4,-2.8 -2,-0.1 5,-0.3 -0.841 16.2-141.4 -95.9 123.2 21.5 36.9 -9.4 34 75 A R H > S+ 0 0 30 -2,-0.6 4,-2.4 1,-0.2 5,-0.2 0.874 100.5 46.0 -49.5 -47.7 18.3 38.7 -10.1 35 76 A Q H > S+ 0 0 22 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.904 112.4 49.6 -67.2 -39.1 17.7 37.0 -13.4 36 77 A Q H > S+ 0 0 122 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.940 113.8 47.1 -63.5 -43.4 18.4 33.5 -12.1 37 78 A L H X S+ 0 0 1 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.886 108.9 53.7 -66.1 -39.6 16.1 34.1 -9.2 38 79 A Q H X S+ 0 0 7 -4,-2.4 4,-1.7 -5,-0.3 -1,-0.2 0.841 106.6 53.4 -63.6 -34.8 13.3 35.5 -11.5 39 80 A E H < S+ 0 0 113 -4,-1.7 4,-0.5 2,-0.2 -1,-0.2 0.907 111.9 44.6 -65.9 -41.5 13.5 32.3 -13.6 40 81 A I H >< S+ 0 0 38 -4,-1.7 3,-1.4 1,-0.2 4,-0.4 0.970 117.2 43.9 -66.5 -52.4 13.0 30.2 -10.5 41 82 A L H >< S+ 0 0 0 -4,-2.8 3,-0.7 1,-0.3 -28,-0.3 0.730 101.7 66.4 -68.1 -22.1 10.2 32.3 -9.1 42 83 A S T 3< S+ 0 0 38 -4,-1.7 -1,-0.3 1,-0.2 -30,-0.3 0.741 104.7 48.0 -70.3 -18.0 8.5 32.6 -12.5 43 84 A Q T < S+ 0 0 98 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 0.514 89.0 105.9 -95.1 -10.7 7.9 28.9 -12.1 44 85 A A < - 0 0 2 -3,-0.7 -32,-0.6 -4,-0.4 2,-0.4 -0.495 64.2-138.0 -71.8 142.9 6.6 29.2 -8.5 45 86 A K - 0 0 90 -2,-0.2 2,-0.8 -33,-0.1 84,-0.3 -0.802 7.7-131.6-108.2 141.5 2.8 28.7 -8.1 46 87 A R - 0 0 81 -2,-0.4 2,-0.7 82,-0.1 80,-0.1 -0.831 30.9-157.1 -88.8 109.1 0.4 30.6 -6.0 47 88 A L >> - 0 0 38 -2,-0.8 4,-1.4 78,-0.4 3,-0.5 -0.827 17.4-165.9 -97.9 112.0 -1.6 27.8 -4.2 48 89 A D H 3> S+ 0 0 80 -2,-0.7 4,-2.8 1,-0.2 5,-0.2 0.856 90.6 59.2 -59.3 -38.9 -5.0 28.7 -2.9 49 90 A S H 3> S+ 0 0 32 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.850 102.2 53.2 -59.4 -37.8 -5.1 25.5 -0.9 50 91 A V H <> S+ 0 0 1 -3,-0.5 4,-1.6 2,-0.2 -1,-0.2 0.881 111.6 46.3 -65.6 -37.3 -2.0 26.6 1.0 51 92 A L H X S+ 0 0 26 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.918 113.2 48.4 -71.5 -42.0 -3.8 29.9 1.8 52 93 A R H < S+ 0 0 172 -4,-2.8 3,-0.2 1,-0.2 -2,-0.2 0.938 113.1 47.7 -63.3 -46.4 -7.0 28.2 2.9 53 94 A L H >< S+ 0 0 97 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.841 109.8 51.9 -63.6 -36.5 -5.1 25.7 5.1 54 95 A M H 3< S+ 0 0 24 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.781 97.0 66.2 -72.6 -25.4 -3.1 28.5 6.7 55 96 A D T 3< 0 0 110 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.342 360.0 360.0 -74.2 10.3 -6.3 30.3 7.5 56 97 A N < 0 0 173 -3,-1.1 -3,-0.2 -5,-0.1 -2,-0.2 0.690 360.0 360.0 66.4 360.0 -6.7 27.3 9.7 57 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 58 109 A G 0 0 80 0, 0.0 2,-0.1 0, 0.0 209,-0.0 0.000 360.0 360.0 360.0 132.2 -17.1 17.0 27.0 59 110 A P + 0 0 57 0, 0.0 213,-0.1 0, 0.0 208,-0.0 0.331 360.0 139.5 -67.2 132.7 -16.1 14.6 28.2 60 111 A N S S- 0 0 85 -2,-0.1 210,-0.1 211,-0.1 208,-0.0 0.227 76.7 -95.7-127.6 10.4 -16.6 13.2 24.7 61 112 A G > + 0 0 7 210,-0.2 4,-2.0 208,-0.1 5,-0.2 0.743 66.3 155.9 80.1 28.9 -13.5 11.1 24.3 62 113 A A H > S+ 0 0 30 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.864 72.5 46.4 -53.7 -46.5 -11.4 13.7 22.5 63 114 A W H > S+ 0 0 5 204,-1.3 4,-3.3 2,-0.2 -1,-0.2 0.909 108.9 55.7 -65.2 -42.1 -8.0 12.3 23.5 64 115 A L H > S+ 0 0 77 203,-1.1 4,-2.1 1,-0.2 -2,-0.2 0.897 109.1 47.8 -58.0 -40.9 -9.0 8.7 22.6 65 116 A R H < S+ 0 0 125 -4,-2.0 4,-0.3 2,-0.2 -1,-0.2 0.896 115.0 44.7 -68.4 -38.5 -9.9 9.9 19.0 66 117 A Y H >< S+ 0 0 47 -4,-1.8 3,-1.3 -5,-0.2 4,-0.5 0.938 112.6 51.7 -69.5 -46.7 -6.6 11.8 18.6 67 118 A R H >X S+ 0 0 80 -4,-3.3 4,-3.0 1,-0.3 3,-1.9 0.895 103.5 56.2 -56.9 -47.2 -4.5 9.0 20.1 68 119 A K T 3< S+ 0 0 150 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.592 93.8 70.3 -67.4 -7.3 -6.0 6.3 17.8 69 120 A K T <4 S+ 0 0 133 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.758 119.4 16.9 -75.5 -25.1 -4.9 8.4 14.8 70 121 A F T <4 S+ 0 0 26 -3,-1.9 2,-1.1 -4,-0.5 -2,-0.2 0.723 113.6 68.5-117.7 -36.2 -1.3 7.5 15.7 71 122 A I < + 0 0 25 -4,-3.0 -1,-0.2 4,-0.1 3,-0.0 -0.705 66.2 130.0 -98.0 87.7 -1.3 4.5 18.1 72 123 A T S > S- 0 0 45 -2,-1.1 4,-2.9 -3,-0.1 5,-0.3 -0.873 70.5-104.8-130.2 161.0 -2.4 1.5 15.9 73 124 A P H > S+ 0 0 95 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.929 121.0 51.3 -54.8 -44.7 -0.9 -2.0 15.4 74 125 A D H > S+ 0 0 88 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.911 113.5 43.5 -60.5 -43.9 0.3 -1.0 12.0 75 126 A N H > S+ 0 0 8 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.927 114.4 48.6 -68.4 -45.9 2.1 2.2 13.2 76 127 A V H X S+ 0 0 19 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.936 113.4 48.6 -60.7 -43.0 3.6 0.5 16.3 77 128 A Q H X S+ 0 0 113 -4,-2.8 4,-2.0 -5,-0.3 -2,-0.2 0.913 112.7 46.7 -64.0 -42.1 4.8 -2.4 14.1 78 129 A N H X S+ 0 0 31 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.857 109.9 55.8 -68.6 -30.6 6.4 0.0 11.5 79 130 A G H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.884 105.3 50.8 -67.0 -39.1 7.8 2.0 14.5 80 131 A V H X S+ 0 0 22 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.938 110.0 50.6 -63.4 -44.4 9.6 -1.2 15.7 81 132 A V H X S+ 0 0 78 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.913 112.1 46.6 -61.1 -42.8 11.0 -1.8 12.2 82 133 A F H X S+ 0 0 9 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.930 111.7 50.7 -65.5 -46.6 12.3 1.8 12.0 83 134 A W H < S+ 0 0 13 -4,-2.5 7,-0.2 2,-0.2 -2,-0.2 0.928 113.4 44.7 -57.2 -49.3 13.9 1.7 15.5 84 135 A N H >< S+ 0 0 84 -4,-2.5 3,-1.1 1,-0.2 4,-0.2 0.917 112.6 52.1 -63.5 -41.5 15.7 -1.6 14.7 85 136 A Q H 3< S+ 0 0 125 -4,-2.4 3,-0.3 1,-0.3 -2,-0.2 0.899 122.0 30.7 -63.1 -39.5 16.8 -0.4 11.3 86 137 A Y T 3X S+ 0 0 46 -4,-2.5 4,-2.6 -5,-0.2 -1,-0.3 0.024 79.8 126.6-111.9 31.3 18.3 2.8 12.8 87 138 A E H <> S+ 0 0 70 -3,-1.1 4,-2.9 1,-0.2 5,-0.2 0.865 72.0 52.2 -57.8 -41.1 19.3 1.5 16.2 88 139 A D H > S+ 0 0 135 -3,-0.3 4,-2.6 -4,-0.2 -1,-0.2 0.933 112.2 45.5 -62.3 -46.2 22.9 2.7 16.0 89 140 A A H > S+ 0 0 7 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.915 113.5 50.8 -62.2 -41.8 21.9 6.2 15.0 90 141 A L H X S+ 0 0 0 -4,-2.6 4,-1.7 -7,-0.2 -2,-0.2 0.932 112.5 45.1 -62.8 -43.8 19.3 6.2 17.7 91 142 A N H X S+ 0 0 53 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.904 112.1 52.6 -66.8 -37.5 21.8 5.1 20.4 92 143 A R H X S+ 0 0 92 -4,-2.6 4,-2.8 -5,-0.2 5,-0.3 0.895 108.2 50.4 -65.2 -38.2 24.4 7.6 19.1 93 144 A A H X>S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 6,-0.7 0.879 109.2 52.2 -68.4 -34.6 21.8 10.4 19.4 94 145 A W H X5S+ 0 0 107 -4,-1.7 4,-1.7 3,-0.2 -2,-0.2 0.928 114.0 43.1 -64.4 -45.8 21.0 9.3 23.0 95 146 A Q H <5S+ 0 0 127 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.907 122.3 38.1 -67.7 -42.9 24.7 9.4 23.9 96 147 A V H <5S+ 0 0 76 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.924 134.6 17.8 -77.0 -44.9 25.5 12.7 22.1 97 148 A Y H <5S- 0 0 42 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.2 0.578 91.1-124.4-107.7 -12.7 22.3 14.6 22.9 98 149 A G << + 0 0 5 -4,-1.7 119,-0.4 -5,-0.6 -4,-0.2 0.628 67.0 131.6 77.9 11.6 20.6 12.8 25.8 99 150 A V - 0 0 0 -6,-0.7 -1,-0.3 117,-0.1 -2,-0.2 -0.889 55.7-126.4-100.3 121.4 17.3 12.4 23.9 100 151 A P >> - 0 0 25 0, 0.0 4,-1.6 0, 0.0 3,-1.2 -0.294 15.7-114.9 -70.4 149.3 16.0 8.8 24.1 101 152 A P H 3> S+ 0 0 10 0, 0.0 4,-3.1 0, 0.0 5,-0.3 0.822 112.1 60.6 -49.8 -39.7 15.1 6.6 21.1 102 153 A E H 3> S+ 0 0 58 1,-0.2 4,-1.9 2,-0.2 202,-0.1 0.851 105.3 47.9 -62.5 -31.8 11.4 6.5 22.0 103 154 A I H <> S+ 0 0 3 -3,-1.2 4,-2.6 2,-0.2 -1,-0.2 0.936 115.3 43.5 -73.0 -45.5 11.1 10.3 21.7 104 155 A I H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 5,-0.2 0.926 116.5 47.6 -65.9 -42.8 12.9 10.5 18.4 105 156 A V H X S+ 0 0 0 -4,-3.1 4,-1.9 1,-0.2 -1,-0.2 0.889 112.7 50.5 -63.9 -39.5 10.9 7.4 17.0 106 157 A G H X S+ 0 0 0 -4,-1.9 4,-2.7 -5,-0.3 5,-0.2 0.912 111.2 47.4 -64.9 -44.2 7.7 9.0 18.3 107 158 A I H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.947 115.0 44.3 -62.4 -51.8 8.4 12.4 16.7 108 159 A I H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 6,-1.6 0.842 114.7 51.7 -65.9 -28.6 9.3 10.9 13.3 109 160 A G H X S+ 0 0 0 -4,-1.9 4,-1.7 4,-0.3 -2,-0.2 0.949 113.2 41.6 -72.0 -47.9 6.3 8.5 13.5 110 161 A V H < S+ 0 0 18 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.912 118.8 47.8 -66.2 -39.3 3.8 11.2 14.2 111 162 A E H < S- 0 0 46 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.922 139.2 -10.5 -69.5 -47.9 5.3 13.6 11.7 112 163 A T H X>S- 0 0 1 -4,-2.1 5,-2.6 60,-0.3 4,-1.1 0.273 87.4-107.1-139.6 10.8 5.7 11.3 8.6 113 164 A R T ><5S- 0 0 89 -4,-1.7 3,-0.7 -5,-0.5 -4,-0.3 0.952 88.3 -50.1 54.5 46.2 5.1 7.7 9.7 114 165 A W T 345S- 0 0 11 -6,-1.6 -1,-0.2 1,-0.2 -5,-0.1 0.904 115.4 -38.5 58.7 50.0 8.8 7.2 9.3 115 166 A G T 345S+ 0 0 20 -7,-0.4 3,-0.3 57,-0.3 -1,-0.2 0.422 114.4 106.6 87.0 1.2 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